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N-{2-[(4-tert-butyl-2,6-dimethylbenzyl)sulfanyl]-1,3-benzothiazol-6-yl}propanamide
SpectraBase Compound ID D40cWobMF0o
InChI InChI=1S/C23H28N2OS2/c1-7-21(26)24-17-8-9-19-20(12-17)28-22(25-19)27-13-18-14(2)10-16(11-15(18)3)23(4,5)6/h8-12H,7,13H2,1-6H3,(H,24,26)
InChIKey SXFRBNHHTNIKMT-UHFFFAOYSA-N
Mol Weight 412.61 g/mol
Molecular Formula C23H28N2OS2
Exact Mass 412.164306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID pWqMiO8SGK
Name N-{2-[(4-tert-butyl-2,6-dimethylbenzyl)sulfanyl]-1,3-benzothiazol-6-yl}propanamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H28N2OS2/c1-7-21(26)24-17-8-9-19-20(12-17)28-22(25-19)27-13-18-14(2)10-16(11-15(18)3)23(4,5)6/h8-12H,7,13H2,1-6H3,(H,24,26)
InChIKey SXFRBNHHTNIKMT-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3034
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D06441; Labnumber: SPKOL-4398; SBI_ID: SBI-003036
Temperature 306 °C